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CHEBI:192253 - 2-methyl-(2E)-pentenoyl-CoA(4−)

ChEBI IDCHEBI:192253
ChEBI Name2-methyl-(2E)-pentenoyl-CoA(4−)
Stars
ASCII Name2-methyl-(2E)-pentenoyl-CoA(4-)
Submitterlaimo
DownloadsMolfile
FormulaC27H40N7O17P3S
Net Charge-4
Average Mass859.638
Monoisotopic Mass859.14362
SMILESCC/C=C(\C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-]
InChIInChI=1S/C27H44N7O17P3S/c1-5-6-15(2)26(39)55-10-9-29-17(35)7-8-30-24(38)21(37)27(3,4)12-48-54(45,46)51-53(43,44)47-11-16-20(50-52(40,41)42)19(36)25(49-16)34-14-33-18-22(28)31-13-32-23(18)34/h6,13-14,16,19-21,25,36-37H,5,7-12H2,1-4H3,(H,29,35)(H,30,38)(H,43,44)(H,45,46)(H2,28,31,32)(H2,40,41,42)/p-4/b15-6+/t16-,19-,20-,21+,25-/m1/s1
InChIKeyFYNQHQFYGJBYBJ-XMGKPRLXSA-J
ChEBI Ontology
Outgoing Relation(s)
2-methyl-(2E)-pentenoyl-CoA(4−) (CHEBI:192253) has functional parent propionyl-CoA(4−) (CHEBI:57392)
2-methyl-(2E)-pentenoyl-CoA(4−) (CHEBI:192253) is a methyl-branched fatty acyl-CoA(4−) (CHEBI:183508)
Synonym  Source
trans-2-methyl-2-pentenoyl-CoA(4−)SUBMITTER
UniProt Name  Source
2-methyl-(2E)-pentenoyl-CoAUniProt
Citations